(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-ethanol

Systemtic Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-ethanol Openeye Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-ethanol CAS Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(1-piperidin-1-iumyl)ethanol IUPAC Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-ylethanol Traditional Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-ethanol Formula: C16H24NO3+ MolecularWeight: 278.36666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C2=CC3=C(C=C2)OCCCO3)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](C2=CC3=C(C=C2)OCCCO3)O

InChI

InChI=1S/C16H23NO3/c18-14(12-17-7-2-1-3-8-17)13-5-6-15-16(11-13)20-10-4-9-19-15/h5-6,11,14,18H,1-4,7-10,12H2/p+1/t14-/m0/s1